Structure Database (LMSD)

Common Name
Myristyl palmitate
Systematic Name
tetradecanyl hexadecanoate
Synonyms
  • WE(14:0/16:0)
  • tetradecyl hexadecanoate
LM ID
LMFA07010002
Formula
C30H60O2
Exact Mass
Calculate m/z
452.45933
Sum Composition
WE 30:0
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty esters [FA07]
Wax monoesters [FA0701]

References

Reference
Netherlands Institute for Sea Research (NIOZ) MBT database
Comments
Submitted by Henry Boumann, Netherlands

String Representations

InChiKey (Click to copy)
UULYVBBLIYLRCU-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C30H60O2/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30(31)32-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h3-29H2,1-2H3
SMILES (Click to copy)
CCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCC

Other Databases

CHEBI ID
84064
PubChem CID
78294
SwissLipids ID
SLM:000389999

Calculated Physicochemical Properties

Heavy Atoms 32
Rings 0
Aromatic Rings 0
Rotatable Bonds 28
Van der Waals Molecular Volume 542.50
Topological Polar Surface Area 26.30
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
logP 11.00
Molar Refractivity 142.84

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Created at
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Updated at
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